Crystallography Open Database





Information card for 2013798

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Coordinates

2013798.cif

Structure factors

2013798.hkl

Structure parameters

Formula - C17 H16 F3 N3 O2 -
Calculated formula - C17 H16 F3 N3 O2 -
Title of publication Four trifluoromethylnitrobenzene analogues
Authors of publication Daniel E. Lynch; Ian McClenaghan
Journal of publication Acta Crystallographica, Section C
Year of publication 2004
Journal volume 60
Pages of publication o1 - o5
a 30.6687 ± 0.0012 Å
b 9.9731 ± 0.0003 Å
c 10.4592 ± 0.0003 Å
α 90°
β 95.8496 ± 0.001°
γ 90°
Cell volume 3182.41 ± 0.18 Å3
Cell temperature 150 ± 2 K
Ambient diffraction temperature 150 ± 2 K
Number of distinct elements 5
Hermann-Mauguin symmetry space group P 1 21/c 1
Hall symmetry space group -P 2ybc
Has coordinates Yes
Has disorder No
Has Fobs Yes

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